![N-(5-ethyl-1,3,4-thiadiazol-2-yl)-4-{[(1E)-3-(4-methylphenyl)-3-oxoprop-1-en-1-yl]amino}benzenesulfonamide structure](/static/products/116/1164550-66-6.png)
N-(5-ethyl-1,3,4-thiadiazol-2-yl)-4-{[(1E)-3-(4-methylphenyl)-3-oxoprop-1-en-1-yl]amino}benzenesulfonamide
TL;DR: N-(5-ethyl-1,3,4-thiadiazol-2-yl)-4-{[(1E)-3-(4-methylphenyl)-3-oxoprop-1-en-1-yl]amino}benzenesulfonamide (CAS 1164550-66-6) is a chemical compound with molecular formula C20H20N4O3S2 and molecular weight 428.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(5-ethyl-1,3,4-thiadiazol-2-yl)-4-[[(E)-3-(4-methylphenyl)-3-oxoprop-1-enyl]amino]benzenesulfonamide
Also Known As: N-(5-ethyl-1,3,4-thiadiazol-2-yl)-4-{[(1E)-3-(4-methylphenyl)-3-oxoprop-1-en-1-yl]amino}benzenesulfonamide, (E)-N-(5-ethyl-1,3,4-thiadiazol-2-yl)-4-((3-oxo-3-(p-tolyl)prop-1-en-1-yl)amino)benzenesulfonamide, N-(5-Ethyl-[1,3,4]thiadiazol-2-yl)-4-((E)-3-oxo-3-p-tolyl-propenylamino)-benzenesulfonamide, N-(5-ethyl-1,3,4-thiadiazol-2-yl)-4-[[(E)-3-(4-methylphenyl)-3-oxoprop-1-enyl]amino]benzenesulfonamide
| Molecular Formula | C20H20N4O3S2 |
|---|---|
| Molecular Weight | 428.10 g/mol |
| LogP | 4.01822 |
| Topological Polar Surface Area | 101.05 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 428.0977 |
| Heavy Atoms | 29 |
| Complexity | 1119.2928 |
Chemical Identifiers
| CAS Number | 1164550-66-6 |
|---|---|
| SMILES | CCC1=NN=C(S1)NS(=O)(=O)C2=CC=C(C=C2)N/C=C/C(=O)C3=CC=C(C=C3)C |
Product Overview
N-(5-ethyl-1,3,4-thiadiazol-2-yl)-4-{[(1E)-3-(4-methylphenyl)-3-oxoprop-1-en-1-yl]amino}benzenesulfonamide (CAS 1164550-66-6), with molecular formula C20H20N4O3S2 and molecular weight 428.10 g/mol. IUPAC: N-(5-ethyl-1,3,4-thiadiazol-2-yl)-4-[[(E)-3-(4-methylphenyl)-3-oxoprop-1-enyl]amino]benzenesulfonamide.
Chemical Property Profile of N-(5-ethyl-1,3,4-thiadiazol-2-yl)-4-{[(1E)-3-(4-methylphenyl)-3-oxoprop-1-en-1-yl]amino}benzenesulfonamide
Property Insights of N-(5-ethyl-1,3,4-thiadiazol-2-yl)-4-{[(1E)-3-(4-methylphenyl)-3-oxoprop-1-en-1-yl]amino}benzenesulfonamide
The XLogP value of 4.01822 indicates that N-(5-ethyl-1,3,4-thiadiazol-2-yl)-4-{[(1E)-3-(4-methylphenyl)-3-oxoprop-1-en-1-yl]amino}benzenesulfonamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 101.05 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(5-ethyl-1,3,4-thiadiazol-2-yl)-4-{[(1E)-3-(4-methylphenyl)-3-oxoprop-1-en-1-yl]amino}benzenesulfonamide. Following Lipinski's Rule of Five, N-(5-ethyl-1,3,4-thiadiazol-2-yl)-4-{[(1E)-3-(4-methylphenyl)-3-oxoprop-1-en-1-yl]amino}benzenesulfonamide has 2 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of N-(5-ethyl-1,3,4-thiadiazol-2-yl)-4-{[(1E)-3-(4-methylphenyl)-3-oxoprop-1-en-1-yl]amino}benzenesulfonamide?
The CAS number of N-(5-ethyl-1,3,4-thiadiazol-2-yl)-4-{[(1E)-3-(4-methylphenyl)-3-oxoprop-1-en-1-yl]amino}benzenesulfonamide is 1164550-66-6.
What is the molecular formula of N-(5-ethyl-1,3,4-thiadiazol-2-yl)-4-{[(1E)-3-(4-methylphenyl)-3-oxoprop-1-en-1-yl]amino}benzenesulfonamide?
The molecular formula of N-(5-ethyl-1,3,4-thiadiazol-2-yl)-4-{[(1E)-3-(4-methylphenyl)-3-oxoprop-1-en-1-yl]amino}benzenesulfonamide is C20H20N4O3S2.
What is the molecular weight of N-(5-ethyl-1,3,4-thiadiazol-2-yl)-4-{[(1E)-3-(4-methylphenyl)-3-oxoprop-1-en-1-yl]amino}benzenesulfonamide?
The molecular weight of N-(5-ethyl-1,3,4-thiadiazol-2-yl)-4-{[(1E)-3-(4-methylphenyl)-3-oxoprop-1-en-1-yl]amino}benzenesulfonamide is 428.10 g/mol.
Where can I buy N-(5-ethyl-1,3,4-thiadiazol-2-yl)-4-{[(1E)-3-(4-methylphenyl)-3-oxoprop-1-en-1-yl]amino}benzenesulfonamide?
You can request a quote for N-(5-ethyl-1,3,4-thiadiazol-2-yl)-4-{[(1E)-3-(4-methylphenyl)-3-oxoprop-1-en-1-yl]amino}benzenesulfonamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(5-ethyl-1,3,4-thiadiazol-2-yl)-4-{[(1E)-3-(4-methylphenyl)-3-oxoprop-1-en-1-yl]amino}benzenesulfonamide?
Yes, KEHONG BIO provides custom synthesis services for N-(5-ethyl-1,3,4-thiadiazol-2-yl)-4-{[(1E)-3-(4-methylphenyl)-3-oxoprop-1-en-1-yl]amino}benzenesulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.